ethanedioic acid; 1-[(4-fluorophenyl)methyl]-4-[(3-phenoxyphenyl)methyl]piperazine

Systemtic Name: ethanedioic acid; 1-[(4-fluorophenyl)methyl]-4-[(3-phenoxyphenyl)methyl]piperazine Openeye Name: 1-[(4-fluorophenyl)methyl]-4-[(3-phenoxyphenyl)methyl]piperazine; oxalic acid CAS Name: 1-[(4-fluorophenyl)methyl]-4-[(3-phenoxyphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-[(4-fluorophenyl)methyl]-4-[(3-phenoxyphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(4-fluorobenzyl)-4-(3-phenoxybenzyl)piperazine; oxalic acid Formula: C26H27FN2O5 MolecularWeight: 466.501383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)F)CC3=CC(=CC=C3)OC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)F)CC3=CC(=CC=C3)OC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H25FN2O.C2H2O4/c25-22-11-9-20(10-12-22)18-26-13-15-27(16-14-26)19-21-5-4-8-24(17-21)28-23-6-2-1-3-7-23;3-1(4)2(5)6/h1-12,17H,13-16,18-19H2;(H,3,4)(H,5,6)